Yixiang Cao

The VSGB 2.0 model: A next generation energy model for high resolution protein structure modeling

Jianing Li, Robert Abel, Kai Zhu et al. · Proteins Structure Function and Bioinformatics · 2011 · 1.1K citations · Full text

Vsgb 2.0, Structural Bioinformatics, Biomolecular Structure Prediction +17

Development of a polarizable force field for proteins via <i>ab initio</i> quantum chemistry: First generation model and gas phase tests

George A. Kaminski, Harry A. Stern, B. J. Berne et al. · Journal of Computational Chemistry · 2002 · 305 citations

Correlated ab Initio Electronic Structure Calculations for Large Molecules

Richard A. Friesner, Robert B. Murphy, Michael D. Beachy et al. · The Journal of Physical Chemistry A · 1999 · 287 citations

Engineering, Physics, Natural Sciences +11

Large Scale ab Initio Quantum Chemical Calculation of the Intermediates in the Soluble Methane Monooxygenase Catalytic Cycle

Barry D. Dunietz, Michael D. Beachy, Yixiang Cao et al. · Journal of the American Chemical Society · 2000 · 181 citations

Electron Density, Engineering, Aldehyde Dehydrogenase +15

A Polarizable Force Field and Continuum Solvation Methodology for Modeling of Protein−Ligand Interactions

Jon R. Maple, Yixiang Cao, Wolfgang Damm et al. · Journal of Chemical Theory and Computation · 2005 · 109 citations

Polarizable Force Field, Engineering, Biochemistry +15